[4-[2-[4-(azepan-1-ylcarbonyloxy)phenyl]propan-2-yl]phenyl] azepane-1-carboxylate

Systemtic Name: [4-[2-[4-(azepan-1-ylcarbonyloxy)phenyl]propan-2-yl]phenyl] azepane-1-carboxylate Openeye Name: [4-[1-[4-(azepane-1-carbonyloxy)phenyl]-1-methyl-ethyl]phenyl] azepane-1-carboxylate CAS Name: 1-azepanecarboxylic acid [4-[2-[4-[1-azepanyl(oxo)methoxy]phenyl]propan-2-yl]phenyl] ester IUPAC Name: [4-[2-[4-(azepane-1-carbonyloxy)phenyl]propan-2-yl]phenyl] azepane-1-carboxylate Traditional Name: azepane-1-carboxylic acid [4-[1-[4-(azepane-1-carbonyloxy)phenyl]-1-methyl-ethyl]phenyl] ester Formula: C29H38N2O4 MolecularWeight: 478.62302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)OC(=O)N2CCCCCC2)C3=CC=C(C=C3)OC(=O)N4CCCCCC4

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)OC(=O)N2CCCCCC2)C3=CC=C(C=C3)OC(=O)N4CCCCCC4

InChI

InChI=1S/C29H38N2O4/c1-29(2,23-11-15-25(16-12-23)34-27(32)30-19-7-3-4-8-20-30)24-13-17-26(18-14-24)35-28(33)31-21-9-5-6-10-22-31/h11-18H,3-10,19-22H2,1-2H3